Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 10/20 | 0.57 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.38 |
| ▸ | HTR5A | P47898 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27725108 | 0.91 | HDAC1 (0.49) | HDAC1HDAC6HDAC3HDAC8HDAC4 | |
| SCHEMBL27704575 | 0.88 | HDAC1 (0.49) | HDAC1HDAC6HDAC3HDAC8HDAC4 | |
| SCHEMBL3131266 | 0.83 | HDAC1 (0.77) | HDAC1HDAC6HDAC3HDAC8HDAC4 | |
| SCHEMBL3131244 | 0.83 | HDAC1 (0.77) | HDAC1HDAC6HDAC3HDAC8HDAC4 | |
| SCHEMBL27704595 | 0.80 | HDAC1 (0.58) | HDAC1HDAC6HDAC3HDAC8HDAC4 | |
| SCHEMBL27656909 | 0.76 | HDAC2 (0.53) | HDAC1HDAC6HDAC3HDAC8HDAC4 | |
| SCHEMBL27885648 | 0.76 | HDAC2 (0.53) | HDAC1HDAC6HDAC3HDAC8HDAC4 | |
| SCHEMBL3149324 | 0.75 | HDAC1 (0.94) | HDAC1HDAC6HDAC3HDAC8HDAC4 | |
| SCHEMBL3149313 | 0.75 | HDAC1 (0.94) | HDAC1HDAC6HDAC3HDAC8HDAC4 | |
| Resminostat SCHEMBL295541 | 0.73 | HDAC1 (1.00) | HDAC1HDAC6HDAC3HDAC8HDAC4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101137623-A | N-sulphonylpyrroles and their use as histone deacetylase inhibitors | NYCOMED GMBH (DE) | 2008-03-05 | — | — | CN | claimed |
| CN-101137623-B | N-sulphonylpyrroles and use thereof as histone deacetylase inhibitors | NYCOMED GMBH | 2013-03-27 | — | — | CN | disclosed |
| CN-101137623-A | N-sulphonylpyrroles and their use as histone deacetylase inhibitors | NYCOMED GMBH (DE) | 2008-03-05 | — | — | CN | disclosed |